#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w4r s GLN 545 N 0.00 4.29 -0.15 -0.14 0.74 -1.26 -4.90 119.66 118.24 2w4r s GLN 545 Ca 0.00 1.56 -0.08 0.00 0.05 0.00 0.00 55.36 56.89 2w4r s GLN 545 Cb 0.00 -2.69 -0.04 0.00 1.10 0.00 0.00 33.01 31.38 2w4r s GLN 545 CO 0.00 -0.04 0.12 -0.65 -0.55 0.00 0.00 175.29 174.17 2w4r s GLN 546 N -2.25 3.74 0.08 1.67 -1.52 -1.26 -4.36 119.66 115.76 2w4r s GLN 546 Ca 0.55 -0.20 0.08 0.00 -1.95 0.00 0.00 55.36 53.84 2w4r s GLN 546 Cb -0.24 -3.25 -0.03 0.00 -0.22 0.00 0.00 33.01 29.27 2w4r s GLN 546 CO 0.30 0.55 -0.22 -0.06 -0.25 0.00 0.00 175.29 175.62 2w4r s PHE 547 N -0.38 1.86 0.21 0.91 0.08 -1.11 -4.92 117.98 114.63 2w4r s PHE 547 Ca 0.11 -0.40 -0.32 0.00 0.12 0.00 0.00 56.93 56.44 2w4r s PHE 547 Cb -0.12 -1.05 -0.15 0.00 -0.57 0.00 0.00 43.02 41.14 2w4r s PHE 547 CO 0.01 0.18 1.25 -2.30 -0.10 0.00 0.00 175.22 174.26 2w4r n PRO 548 N 1.33 1.53 0.27 0.24 -0.02 -1.26 -4.61 135.00 132.48 2w4r n PRO 548 Ca -0.19 0.54 0.18 0.00 -2.02 0.00 0.00 63.50 62.02 2w4r n PRO 548 Cb 0.53 -2.10 0.94 0.00 -0.02 0.00 0.00 33.50 32.86 2w4r n PRO 548 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 2w4r h VAL 549 N 2.76 0.00 0.00 -1.45 3.04 -1.93 0.32 116.25 118.98 2w4r h VAL 549 Ca -0.44 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.16 2w4r h VAL 549 Cb 1.32 0.94 0.00 0.00 -2.01 0.00 0.00 31.29 31.54 2w4r h VAL 549 CO 0.71 0.00 0.00 1.21 -1.01 0.00 0.00 177.57 178.48 2w4r n GLU 550 N -2.82 0.16 -0.23 4.17 2.13 -1.26 -2.32 120.64 120.47 2w4r n GLU 550 Ca -0.02 0.28 0.12 0.00 0.66 0.00 0.00 57.16 58.19 2w4r n GLU 550 Cb 0.11 -1.75 0.25 0.00 0.27 0.00 0.00 31.44 30.32 2w4r n GLU 550 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 2w4r n HIS 551 N -2.04 0.61 -3.91 4.31 8.25 0.11 -4.63 115.22 117.91 2w4r n HIS 551 Ca 0.04 -0.30 -0.35 0.00 -0.26 0.00 0.00 57.72 56.85 2w4r n HIS 551 Cb 0.30 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.27 2w4r n HIS 551 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2w4r s VAL 552 N -1.39 3.24 0.25 1.59 1.01 -1.04 -3.90 120.40 120.16 2w4r s VAL 552 Ca 0.41 -0.74 0.07 0.00 0.00 0.00 0.00 61.98 61.72 2w4r s VAL 552 Cb 0.23 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 2w4r s VAL 552 CO 0.31 0.29 0.16 -1.10 0.00 0.00 0.00 175.10 174.76 2w4r s GLN 553 N 1.42 2.82 -0.16 2.72 -1.52 -1.06 -0.91 119.66 122.96 2w4r s GLN 553 Ca 0.03 -1.11 -0.05 0.00 -1.95 0.00 0.00 55.36 52.28 2w4r s GLN 553 Cb -0.16 -2.50 -0.03 0.00 -0.22 0.00 0.00 33.01 30.10 2w4r s GLN 553 CO -0.03 0.40 0.01 -0.51 -0.25 0.00 0.00 175.29 174.91 2w4r s LEU 554 N -3.79 3.55 0.18 2.90 1.02 0.75 -0.88 118.68 122.42 2w4r s LEU 554 Ca 0.32 -0.01 0.10 0.00 0.02 0.00 0.00 54.13 54.56 2w4r s LEU 554 Cb -0.08 -1.87 -0.04 0.00 0.02 0.00 0.00 46.19 44.22 2w4r s LEU 554 CO 0.24 0.18 -0.20 -0.76 0.02 0.00 0.00 176.35 175.84 2w4r s LEU 555 N 0.29 2.45 0.06 1.79 1.43 -0.09 0.01 118.68 124.63 2w4r s LEU 555 Ca 0.00 -0.88 -0.31 0.00 -1.03 0.00 0.00 54.13 51.91 2w4r s LEU 555 Cb -0.13 -0.94 -0.06 0.00 0.03 0.00 0.00 46.19 45.09 2w4r s LEU 555 CO 0.02 0.01 1.23 0.00 0.23 0.00 0.00 176.35 177.83 2w4r h ILE 557 N 4.51 1.06 0.23 0.00 -0.00 -1.77 0.26 117.51 121.79 2w4r h ILE 557 Ca -0.41 -0.16 -0.01 0.00 -0.00 0.00 0.00 64.86 64.28 2w4r h ILE 557 Cb 1.21 0.56 0.00 0.00 -0.00 0.00 0.00 36.82 38.59 2w4r h ILE 557 CO 0.82 0.08 -0.11 -1.13 -0.00 0.00 0.00 178.15 177.82 2w4r h ASN 558 N 0.46 -0.26 -0.00 2.16 -0.00 -1.92 -3.26 115.58 112.75 2w4r h ASN 558 Ca 0.15 0.01 0.00 0.00 -0.00 0.00 0.00 56.30 56.46 2w4r h ASN 558 Cb 0.05 0.07 0.00 0.00 -0.00 0.00 0.00 38.32 38.43 2w4r h ASN 558 CO -0.03 0.08 -0.78 0.00 -0.00 0.00 0.00 177.43 176.70 2w4r n MET 560 N -1.05 -1.16 -1.73 0.00 2.81 0.87 -3.72 117.12 113.14 2w4r n MET 560 Ca 0.05 0.46 -0.42 0.00 -1.81 0.00 0.00 57.70 55.98 2w4r n MET 560 Cb 0.34 -4.42 -0.02 0.00 -0.71 0.00 0.00 33.22 28.41 2w4r n MET 560 CO 0.00 0.00 0.00 1.55 1.51 0.00 0.00 175.97 179.03 2w4r n VAL 561 N -2.44 0.92 -2.41 2.03 3.14 -1.26 -3.62 118.33 114.68 2w4r n VAL 561 Ca -0.03 -0.23 -0.43 0.00 -2.96 0.00 0.00 64.34 60.69 2w4r n VAL 561 Cb 0.34 -1.88 -0.02 0.00 -1.06 0.00 0.00 33.84 31.21 2w4r n VAL 561 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2w4r s ALA 562 N 0.09 3.61 0.00 1.55 0.00 -1.27 -1.45 121.76 124.29 2w4r s ALA 562 Ca 0.66 0.55 0.00 0.00 0.00 0.00 0.00 51.96 53.16 2w4r s ALA 562 Cb -0.52 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.00 2w4r s ALA 562 CO 0.47 -1.05 0.00 1.33 0.00 0.00 0.00 175.76 176.52 2w4r n VAL 563 N 5.11 0.00 -3.31 0.00 0.24 0.48 -4.41 118.33 116.44 2w4r n VAL 563 Ca 0.13 -0.40 0.00 0.00 -2.04 0.00 0.00 64.34 62.03 2w4r n VAL 563 Cb 0.45 0.93 0.00 0.00 -1.47 0.00 0.00 33.84 33.76 2w4r n VAL 563 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2w4r n GLY 564 N 1.07 -0.61 3.07 7.63 0.00 -1.11 -4.50 105.19 110.73 2w4r n GLY 564 Ca 0.00 -0.77 -0.20 0.00 0.00 0.00 0.00 46.02 45.04 2w4r n GLY 564 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2w4r s HIS 565 N -3.00 1.05 0.52 1.61 3.76 -1.26 0.13 115.29 118.10 2w4r s HIS 565 Ca 0.00 -0.21 0.31 0.00 -0.15 0.00 0.00 55.06 55.02 2w4r s HIS 565 Cb 0.00 -0.67 1.77 0.00 1.11 0.00 0.00 32.58 34.79 2w4r s HIS 565 CO 0.00 -0.02 2.20 0.78 -0.85 0.00 0.00 174.74 176.86 2w4r h GLY 566 N 5.79 0.00 2.00 -2.22 0.00 -1.33 -0.48 103.07 106.83 2w4r h GLY 566 Ca -0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.00 2w4r h GLY 566 CO 0.49 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.89 2w4r n SER 567 N -3.62 0.49 -0.06 0.19 3.41 -1.23 -2.60 113.62 110.20 2w4r n SER 567 Ca -0.02 0.62 0.11 0.00 -0.26 0.00 0.00 58.87 59.32 2w4r n SER 567 Cb 0.14 -0.73 0.10 0.00 -0.26 0.00 0.00 64.21 63.47 2w4r n SER 567 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2w4r n ASP 568 N -2.04 0.84 -4.79 4.04 8.00 -0.21 -4.78 116.55 117.62 2w4r n ASP 568 Ca 0.02 -0.68 -0.36 0.00 0.71 0.00 0.00 54.79 54.48 2w4r n ASP 568 Cb 0.21 0.55 -0.05 0.00 -0.02 0.00 0.00 41.12 41.81 2w4r n ASP 568 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2w4r s LEU 569 N -2.92 4.16 0.12 0.64 1.43 -1.12 -1.25 118.68 119.75 2w4r s LEU 569 Ca 0.12 1.95 0.01 0.00 -1.03 0.00 0.00 54.13 55.18 2w4r s LEU 569 Cb 0.17 -4.19 -0.04 0.00 0.03 0.00 0.00 46.19 42.16 2w4r s LEU 569 CO 0.74 -0.38 -0.02 -0.13 0.23 0.00 0.00 176.35 176.79 2w4r s ARG 570 N -2.47 0.90 -0.29 1.70 1.81 0.82 -4.33 118.95 117.09 2w4r s ARG 570 Ca 0.56 -1.40 -0.04 0.00 -1.72 0.00 0.00 55.73 53.14 2w4r s ARG 570 Cb -0.20 -0.11 0.03 0.00 -0.45 0.00 0.00 34.95 34.23 2w4r s ARG 570 CO 0.25 -0.10 0.02 0.21 -0.68 0.00 0.00 175.30 175.01 2w4r s LYS 571 N -3.90 2.77 -0.08 3.54 2.20 -0.49 -1.46 119.74 122.31 2w4r s LYS 571 Ca 0.17 -1.05 -0.17 0.00 -0.36 0.00 0.00 55.97 54.56 2w4r s LYS 571 Cb 0.06 -3.23 -0.05 0.00 -1.51 0.00 0.00 37.83 33.10 2w4r s LYS 571 CO -0.02 -0.52 0.45 0.08 -0.36 0.00 0.00 175.35 174.99 2w4r s VAL 572 N 1.37 5.13 -1.52 4.02 1.01 0.14 -0.77 120.40 129.79 2w4r s VAL 572 Ca -0.01 0.91 -0.12 0.00 0.00 0.00 0.00 61.98 62.76 2w4r s VAL 572 Cb -0.18 -3.78 0.12 0.00 0.00 0.00 0.00 36.38 32.54 2w4r s VAL 572 CO -0.00 0.41 0.30 -1.84 0.00 0.00 0.00 175.10 173.96 2w4r n GLU 573 N 3.09 -0.83 0.00 2.72 0.28 -1.26 -1.16 120.64 123.47 2w4r n GLU 573 Ca -0.09 0.10 0.00 0.00 -0.16 0.00 0.00 57.16 57.01 2w4r n GLU 573 Cb 0.52 -3.68 0.00 0.00 1.43 0.00 0.00 31.44 29.71 2w4r n GLU 573 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2w4r n GLY 574 N -1.58 1.46 0.00 -1.84 0.00 -1.26 -4.58 105.19 97.39 2w4r n GLY 574 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2w4r n GLY 574 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2w4r n THR 575 N -1.01 0.00 -1.74 2.61 -1.04 -0.39 -4.92 114.28 107.79 2w4r n THR 575 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 2w4r n THR 575 Cb 0.00 -0.75 -0.01 0.00 -1.82 0.00 0.00 70.33 67.75 2w4r n THR 575 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2w4r n HIS 576 N -0.97 2.76 -3.88 -1.42 8.25 -0.90 -4.51 115.22 114.55 2w4r n HIS 576 Ca 0.00 0.31 -0.36 0.00 -0.26 0.00 0.00 57.72 57.42 2w4r n HIS 576 Cb 0.00 -2.56 -0.11 0.00 1.12 0.00 0.00 29.99 28.44 2w4r n HIS 576 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2w4r s HIS 577 N -0.19 3.17 0.10 4.41 3.76 -1.26 0.40 115.29 125.68 2w4r s HIS 577 Ca 0.63 -0.12 0.09 0.00 -0.15 0.00 0.00 55.06 55.50 2w4r s HIS 577 Cb -0.52 -2.17 -0.03 0.00 1.11 0.00 0.00 32.58 30.97 2w4r s HIS 577 CO 0.51 -0.08 -0.22 0.14 -0.85 0.00 0.00 174.74 174.24 2w4r s VAL 578 N 1.01 1.81 -0.22 -0.90 -7.23 -0.62 -0.57 120.40 113.67 2w4r s VAL 578 Ca 0.04 -1.55 -0.15 0.00 -1.81 0.00 0.00 61.98 58.52 2w4r s VAL 578 Cb -0.14 -1.63 -0.04 0.00 0.56 0.00 0.00 36.38 35.13 2w4r s VAL 578 CO 0.03 -0.01 0.34 0.21 -0.31 0.00 0.00 175.10 175.37 2w4r s ASN 579 N -1.87 6.33 -0.17 4.85 3.84 -1.10 0.03 114.94 126.86 2w4r s ASN 579 Ca 0.08 0.38 0.16 0.00 0.21 0.00 0.00 52.86 53.69 2w4r s ASN 579 Cb -0.10 -2.20 0.70 0.00 -0.55 0.00 0.00 41.25 39.10 2w4r s ASN 579 CO 0.04 -0.07 1.62 1.33 -2.79 0.00 0.00 177.10 177.23 2w4r n VAL 580 N 4.50 2.24 -3.32 -5.21 0.24 -0.50 -4.24 118.33 112.03 2w4r n VAL 580 Ca -0.10 -1.40 -0.39 0.00 -2.04 0.00 0.00 64.34 60.42 2w4r n VAL 580 Cb 0.51 -0.08 -0.07 0.00 -1.47 0.00 0.00 33.84 32.73 2w4r n VAL 580 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 2w4r s ASN 581 N -1.06 6.49 0.28 -1.34 3.84 -1.26 -4.82 114.94 117.06 2w4r s ASN 581 Ca 0.49 0.58 0.24 0.00 0.21 0.00 0.00 52.86 54.38 2w4r s ASN 581 Cb 0.35 -2.26 1.01 0.00 -0.55 0.00 0.00 41.25 39.81 2w4r s ASN 581 CO 0.18 -0.14 1.73 -0.81 -2.79 0.00 0.00 177.10 175.27 2w4r n PRO 582 N 4.69 0.21 0.22 0.43 -0.04 -1.26 -1.48 135.00 137.76 2w4r n PRO 582 Ca -0.07 0.44 0.10 0.00 -0.04 0.00 0.00 63.50 63.94 2w4r n PRO 582 Cb 0.51 -1.90 0.43 0.00 -0.04 0.00 0.00 33.50 32.49 2w4r n PRO 582 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 2w4r h ASN 583 N 0.00 0.00 -1.00 3.54 2.35 -2.00 -3.21 115.58 115.26 2w4r h ASN 583 Ca 0.00 0.00 0.17 0.00 -0.55 0.00 0.00 56.30 55.92 2w4r h ASN 583 Cb 0.36 0.00 -0.10 0.00 0.05 0.00 0.00 38.32 38.63 2w4r h ASN 583 CO 0.00 0.22 0.62 0.15 -1.65 0.00 0.00 177.43 176.77 2w4r h PHE 584 N 0.00 1.07 0.00 1.19 3.57 -1.65 0.12 116.94 121.24 2w4r h PHE 584 Ca -0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2w4r h PHE 584 Cb 0.79 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 39.21 2w4r h PHE 584 CO 0.00 0.30 0.06 -1.13 -2.23 0.00 0.00 178.31 175.31 2w4r n SER 585 N -4.70 0.35 0.04 0.41 3.41 -1.23 -0.04 113.62 111.85 2w4r n SER 585 Ca 0.22 0.63 0.10 0.00 -0.26 0.00 0.00 58.87 59.56 2w4r n SER 585 Cb 0.51 -0.66 0.41 0.00 -0.26 0.00 0.00 64.21 64.20 2w4r n SER 585 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2w4r n ASN 586 N -1.97 0.21 -0.25 4.04 5.03 0.41 -3.22 115.26 119.51 2w4r n ASN 586 Ca -0.01 0.54 0.05 0.00 0.87 0.00 0.00 54.58 56.03 2w4r n ASN 586 Cb 0.08 -0.59 0.01 0.00 -1.02 0.00 0.00 39.78 38.25 2w4r n ASN 586 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2w4r n TYR 587 N -1.73 0.00 -4.19 3.10 4.01 0.59 -4.65 117.16 114.29 2w4r n TYR 587 Ca 0.04 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.66 2w4r n TYR 587 Cb 0.23 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.16 2w4r n TYR 587 CO 0.00 0.00 0.00 1.52 -0.46 0.00 0.00 176.86 177.92 2w4r s TYR 588 N -1.27 0.98 0.05 -0.72 1.13 -1.23 -1.20 117.35 115.10 2w4r s TYR 588 Ca 0.09 -0.86 0.04 0.00 -1.41 0.00 0.00 57.07 54.93 2w4r s TYR 588 Cb 0.08 -0.55 -0.04 0.00 -1.10 0.00 0.00 41.96 40.36 2w4r s TYR 588 CO 0.23 -0.09 -0.04 -0.80 -2.51 0.00 0.00 175.55 172.35 2w4r s ASN 589 N -3.01 4.82 -0.08 -0.18 0.01 -0.08 -4.55 114.94 111.88 2w4r s ASN 589 Ca 0.12 -0.17 -0.02 0.00 -0.71 0.00 0.00 52.86 52.09 2w4r s ASN 589 Cb 0.04 -1.13 -0.03 0.00 0.41 0.00 0.00 41.25 40.54 2w4r s ASN 589 CO -0.03 0.23 0.00 -0.69 -1.51 0.00 0.00 177.10 175.10 2w4r s VAL 590 N -1.16 4.31 0.04 1.60 1.01 -1.26 -1.60 120.40 123.35 2w4r s VAL 590 Ca 0.21 -0.27 0.01 0.00 0.00 0.00 0.00 61.98 61.93 2w4r s VAL 590 Cb -0.11 -2.82 -0.03 0.00 0.00 0.00 0.00 36.38 33.42 2w4r s VAL 590 CO 0.13 0.59 -0.05 -0.94 0.00 0.00 0.00 175.10 174.83 2w4r s SER 591 N -0.94 0.55 -0.14 3.32 1.04 -0.44 -4.74 113.70 112.35 2w4r s SER 591 Ca 0.14 -0.68 0.03 0.00 0.48 0.00 0.00 55.95 55.93 2w4r s SER 591 Cb -0.11 0.10 0.29 0.00 0.10 0.00 0.00 66.02 66.40 2w4r s SER 591 CO 0.03 -0.36 1.20 0.54 0.98 0.00 0.00 173.24 175.63 2w4r n ARG 592 N 1.06 1.97 -0.42 4.02 1.74 -1.26 0.11 116.66 123.89 2w4r n ARG 592 Ca -0.20 -1.22 0.36 0.00 -0.77 0.00 0.00 57.85 56.01 2w4r n ARG 592 Cb 0.57 -1.62 0.60 0.00 -1.02 0.00 0.00 32.46 30.99 2w4r n ARG 592 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2w4r n ASP 593 N 0.03 0.18 0.00 0.55 4.64 -1.26 -4.82 116.55 115.86 2w4r n ASP 593 Ca 0.18 1.19 0.00 0.00 -1.38 0.00 0.00 54.79 54.78 2w4r n ASP 593 Cb 0.82 -0.59 0.00 0.00 -1.04 0.00 0.00 41.12 40.31 2w4r n ASP 593 CO 0.00 0.00 0.00 0.79 -0.82 0.00 0.00 177.20 177.17 2w4r n TRP 604 N -4.41 0.00 -3.47 -0.67 5.03 -1.23 -4.76 117.44 107.93 2w4r n TRP 604 Ca 0.35 0.00 -0.40 0.00 3.03 0.00 0.00 57.50 60.48 2w4r n TRP 604 Cb 1.39 0.00 -0.10 0.00 -1.03 0.00 0.00 31.31 31.57 2w4r n TRP 604 CO 0.00 0.00 0.00 0.21 -0.03 0.00 0.00 177.69 177.87 2w4r s LYS 605 N 0.00 3.62 0.40 -0.99 2.47 0.13 -4.78 119.74 120.59 2w4r s LYS 605 Ca 0.00 -0.45 -0.24 0.00 -1.56 0.00 0.00 55.97 53.72 2w4r s LYS 605 Cb 0.00 -3.78 -0.12 0.00 -1.46 0.00 0.00 37.83 32.47 2w4r s LYS 605 CO 0.00 -0.43 0.68 -2.30 0.16 0.00 0.00 175.35 173.46 2w4r n PRO 606 N 5.24 0.77 0.00 4.03 -0.02 -1.26 0.90 135.00 144.65 2w4r n PRO 606 Ca -0.11 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 2w4r n PRO 606 Cb 0.50 -1.62 0.00 0.00 -0.02 0.00 0.00 33.50 32.36 2w4r n PRO 606 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2w4r n GLY 607 N 1.62 0.00 0.00 -1.23 0.00 -0.05 -4.64 105.19 100.90 2w4r n GLY 607 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2w4r n GLY 607 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w4r n GLY 608 N 0.84 -0.01 3.80 -0.02 0.00 -0.98 -4.66 105.19 104.17 2w4r n GLY 608 Ca 0.00 -1.01 -0.36 0.00 0.00 0.00 0.00 46.02 44.64 2w4r n GLY 608 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2w4r s VAL 609 N -2.00 5.17 -0.20 1.61 1.01 0.28 0.13 120.40 126.40 2w4r s VAL 609 Ca 0.00 0.08 -0.10 0.00 0.00 0.00 0.00 61.98 61.96 2w4r s VAL 609 Cb 0.00 -3.25 -0.05 0.00 0.00 0.00 0.00 36.38 33.08 2w4r s VAL 609 CO 0.00 0.59 0.14 -0.63 0.00 0.00 0.00 175.10 175.20 2w4r s ILE 610 N -0.79 5.41 0.02 2.22 -1.09 0.58 -1.15 121.20 126.40 2w4r s ILE 610 Ca 0.13 0.21 -0.08 0.00 -2.23 0.00 0.00 60.65 58.68 2w4r s ILE 610 Cb -0.12 -3.48 0.00 0.00 -1.58 0.00 0.00 42.46 37.29 2w4r s ILE 610 CO 0.03 0.44 0.16 -0.94 -1.23 0.00 0.00 174.94 173.40 2w4r s SER 611 N 0.35 0.05 0.11 3.58 1.04 -0.75 -0.20 113.70 117.88 2w4r s SER 611 Ca 0.09 -0.33 -0.31 0.00 0.48 0.00 0.00 55.95 55.88 2w4r s SER 611 Cb -0.11 0.25 -0.10 0.00 0.10 0.00 0.00 66.02 66.16 2w4r s SER 611 CO -0.02 -0.48 1.82 0.00 0.98 0.00 0.00 173.24 175.55 2w4r h ARG 613 N 8.74 0.89 -0.18 0.00 3.08 -1.59 0.60 114.38 125.92 2w4r h ARG 613 Ca -0.46 -0.10 -0.04 0.00 0.07 0.00 0.00 59.98 59.45 2w4r h ARG 613 Cb 1.22 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 31.09 2w4r h ARG 613 CO 0.95 0.67 -0.03 -0.97 -1.07 0.00 0.00 179.97 179.52 2w4r h ASN 614 N 0.89 0.34 0.00 7.04 -1.24 -1.91 -3.27 115.58 117.43 2w4r h ASN 614 Ca 0.22 -0.35 0.00 0.00 0.71 0.00 0.00 56.30 56.89 2w4r h ASN 614 Cb 0.06 -0.09 0.00 0.00 0.73 0.00 0.00 38.32 39.02 2w4r h ASN 614 CO -0.03 0.61 0.00 0.00 -1.29 0.00 0.00 177.43 176.71 2w4r n GLY 616 N 0.21 0.53 3.71 0.00 0.00 0.21 -4.54 105.19 105.30 2w4r n GLY 616 Ca 0.00 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 2w4r n GLY 616 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2w4r s GLU 617 N -0.15 4.19 0.19 1.61 2.56 -1.26 -4.15 118.70 121.68 2w4r s GLU 617 Ca 0.00 2.41 -0.30 0.00 0.00 0.00 0.00 54.97 57.08 2w4r s GLU 617 Cb 0.00 -3.30 -0.08 0.00 2.00 0.00 0.00 34.13 32.75 2w4r s GLU 617 CO 0.00 -0.68 1.22 0.08 -0.56 0.00 0.00 175.26 175.32 2w4r s VAL 618 N 1.67 3.51 -0.01 3.70 1.01 -1.26 0.13 120.40 129.15 2w4r s VAL 618 Ca 0.73 1.26 0.04 0.00 0.00 0.00 0.00 61.98 64.01 2w4r s VAL 618 Cb -0.44 -3.81 -0.07 0.00 0.00 0.00 0.00 36.38 32.07 2w4r s VAL 618 CO 0.32 0.20 0.09 0.79 0.00 0.00 0.00 175.10 176.50 2w4r n TRP 619 N 2.55 0.00 0.00 5.22 8.01 0.45 -4.63 117.44 129.03 2w4r n TRP 619 Ca 0.05 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.24 2w4r n TRP 619 Cb 0.44 -0.11 0.00 0.00 -2.01 0.00 0.00 31.31 29.64 2w4r n TRP 619 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2w4r n GLY 620 N 2.29 -0.22 3.47 6.99 0.00 -1.18 -0.91 105.19 115.63 2w4r n GLY 620 Ca -0.01 -0.93 -0.26 0.00 0.00 0.00 0.00 46.02 44.81 2w4r n GLY 620 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2w4r s LEU 621 N 0.00 2.61 -0.51 0.99 1.43 -0.56 -0.13 118.68 122.50 2w4r s LEU 621 Ca 0.00 -0.80 -0.17 0.00 -1.03 0.00 0.00 54.13 52.13 2w4r s LEU 621 Cb 0.00 -1.30 0.09 0.00 0.03 0.00 0.00 46.19 45.01 2w4r s LEU 621 CO 0.00 0.11 0.51 -1.58 0.23 0.00 0.00 176.35 175.61 2w4r s GLN 622 N -2.82 3.02 -0.08 1.70 0.74 0.99 0.68 119.66 123.88 2w4r s GLN 622 Ca 0.23 -1.36 -0.01 0.00 0.05 0.00 0.00 55.36 54.26 2w4r s GLN 622 Cb -0.08 -4.19 -0.03 0.00 1.10 0.00 0.00 33.01 29.81 2w4r s GLN 622 CO 0.12 -1.21 -0.01 -1.64 -0.55 0.00 0.00 175.29 172.00 2w4r s MET 623 N 1.95 2.94 -0.17 1.67 -1.94 -0.46 -0.74 119.30 122.55 2w4r s MET 623 Ca 0.07 -0.43 -0.13 0.00 -1.71 0.00 0.00 55.69 53.48 2w4r s MET 623 Cb -0.25 -2.76 -0.05 0.00 2.01 0.00 0.00 34.83 33.78 2w4r s MET 623 CO 0.06 0.70 0.26 0.42 -0.01 0.00 0.00 175.02 176.45 2w4r s ILE 624 N -0.89 5.33 -0.09 2.53 -1.09 0.24 -1.43 121.20 125.80 2w4r s ILE 624 Ca 0.14 0.48 -0.04 0.00 -2.23 0.00 0.00 60.65 59.00 2w4r s ILE 624 Cb -0.11 -3.60 0.05 0.00 -1.58 0.00 0.00 42.46 37.21 2w4r s ILE 624 CO 0.03 0.40 0.19 -0.47 -1.23 0.00 0.00 174.94 173.85 2w4r s TYR 625 N 0.45 -0.24 -1.61 3.97 6.14 0.54 0.32 117.35 126.93 2w4r s TYR 625 Ca 0.15 0.66 -0.11 0.00 0.64 0.00 0.00 57.07 58.40 2w4r s TYR 625 Cb -0.13 -0.12 0.10 0.00 0.42 0.00 0.00 41.96 42.24 2w4r s TYR 625 CO 0.03 -0.24 0.58 1.63 0.64 0.00 0.00 175.55 178.18 2w4r n LYS 626 N 4.77 -2.83 -1.06 4.97 5.02 -1.26 -0.26 118.16 127.52 2w4r n LYS 626 Ca -0.16 0.34 -0.02 0.00 -2.02 0.00 0.00 58.31 56.45 2w4r n LYS 626 Cb 0.51 -4.74 -0.01 0.00 -0.02 0.00 0.00 35.03 30.77 2w4r n LYS 626 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2w4r n SER 627 N -2.77 -4.20 -4.39 4.39 7.64 -1.26 -4.91 113.62 108.12 2w4r n SER 627 Ca -0.08 0.05 -0.34 0.00 1.01 0.00 0.00 58.87 59.50 2w4r n SER 627 Cb 0.57 -1.87 -0.13 0.00 -1.01 0.00 0.00 64.21 61.77 2w4r n SER 627 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2w4r s VAL 628 N -1.75 3.50 -0.41 0.44 1.01 0.52 -4.98 120.40 118.74 2w4r s VAL 628 Ca 0.00 -0.48 -0.29 0.00 0.00 0.00 0.00 61.98 61.21 2w4r s VAL 628 Cb 0.00 -2.55 0.02 0.00 0.00 0.00 0.00 36.38 33.86 2w4r s VAL 628 CO 0.00 0.47 1.19 -0.54 0.00 0.00 0.00 175.10 176.22 2w4r s LYS 629 N 0.82 3.80 -0.05 2.72 1.02 -1.26 -0.23 119.74 126.57 2w4r s LYS 629 Ca -0.02 0.82 0.05 0.00 0.02 0.00 0.00 55.97 56.85 2w4r s LYS 629 Cb -0.15 -3.88 -0.01 0.00 -0.52 0.00 0.00 37.83 33.27 2w4r s LYS 629 CO 0.01 -1.27 -0.21 -0.51 -0.92 0.00 0.00 175.35 172.46 2w4r s LEU 630 N 4.42 1.99 -0.17 3.17 1.43 -0.59 -4.86 118.68 124.07 2w4r s LEU 630 Ca 0.51 -0.42 -0.29 0.00 -1.03 0.00 0.00 54.13 52.89 2w4r s LEU 630 Cb -0.10 -1.14 -0.01 0.00 0.03 0.00 0.00 46.19 44.97 2w4r s LEU 630 CO 0.27 0.20 1.15 -2.16 0.23 0.00 0.00 176.35 176.04 2w4r s PRO 631 N -0.11 4.27 -0.30 1.29 0.04 -1.26 -1.22 135.00 137.72 2w4r s PRO 631 Ca -0.02 1.52 -0.10 0.00 0.04 0.00 0.00 61.00 62.44 2w4r s PRO 631 Cb -0.12 -3.67 -0.02 0.00 0.04 0.00 0.00 34.50 30.73 2w4r s PRO 631 CO 0.02 -0.61 0.16 0.08 0.04 0.00 0.00 177.00 176.70 2w4r s VAL 632 N 3.09 4.83 -0.14 -0.36 1.01 0.19 -2.55 120.40 126.47 2w4r s VAL 632 Ca 0.50 -0.20 -0.08 0.00 0.00 0.00 0.00 61.98 62.20 2w4r s VAL 632 Cb -0.19 -3.39 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 2w4r s VAL 632 CO 0.13 0.14 0.13 -0.76 0.00 0.00 0.00 175.10 174.74 2w4r s LEU 633 N 1.67 4.28 0.22 3.92 1.43 0.10 -1.33 118.68 128.97 2w4r s LEU 633 Ca 0.06 0.38 -0.30 0.00 -1.03 0.00 0.00 54.13 53.24 2w4r s LEU 633 Cb -0.17 -2.06 -0.08 0.00 0.03 0.00 0.00 46.19 43.91 2w4r s LEU 633 CO 0.08 0.34 1.08 -0.54 0.23 0.00 0.00 176.35 177.54 2w4r s LYS 634 N -0.61 4.64 0.21 1.70 1.02 -0.27 -4.41 119.74 122.03 2w4r s LYS 634 Ca 0.13 1.72 -0.10 0.00 0.02 0.00 0.00 55.97 57.74 2w4r s LYS 634 Cb -0.12 -3.25 0.29 0.00 -0.52 0.00 0.00 37.83 34.23 2w4r s LYS 634 CO 0.02 0.18 1.69 0.28 -0.92 0.00 0.00 175.35 176.60 2w4r h VAL 635 N 3.43 0.60 0.00 3.17 2.07 -1.90 -1.73 116.25 121.89 2w4r h VAL 635 Ca -0.45 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.00 2w4r h VAL 635 Cb 1.21 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 2w4r h VAL 635 CO 0.70 0.04 0.00 0.54 0.02 0.00 0.00 177.57 178.87 2w4r n ARG 636 N -5.17 0.05 0.16 1.57 1.74 -1.26 -2.52 116.66 111.23 2w4r n ARG 636 Ca 0.09 0.25 0.12 0.00 -0.77 0.00 0.00 57.85 57.54 2w4r n ARG 636 Cb 0.33 -1.59 0.24 0.00 -1.02 0.00 0.00 32.46 30.41 2w4r n ARG 636 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2w4r h SER 637 N 0.00 0.00 -3.60 0.55 4.64 -1.64 -3.35 113.55 110.14 2w4r h SER 637 Ca 0.00 -0.02 -0.68 0.00 -0.47 0.00 0.00 61.79 60.62 2w4r h SER 637 Cb 0.33 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 62.15 2w4r h SER 637 CO 0.00 0.01 -0.64 -0.04 -0.87 0.00 0.00 176.83 175.29 2w4r s MET 638 N -3.18 2.99 0.01 4.77 -1.94 -1.11 -2.12 119.30 118.72 2w4r s MET 638 Ca 0.08 -0.92 -0.30 0.00 -1.71 0.00 0.00 55.69 52.84 2w4r s MET 638 Cb 0.09 -3.34 -0.05 0.00 2.01 0.00 0.00 34.83 33.55 2w4r s MET 638 CO 0.66 -0.47 1.19 -1.17 -0.01 0.00 0.00 175.02 175.22 2w4r s LEU 639 N 1.46 4.33 -0.26 -0.03 2.96 0.30 -4.31 118.68 123.14 2w4r s LEU 639 Ca 0.02 1.92 -0.13 0.00 -0.22 0.00 0.00 54.13 55.71 2w4r s LEU 639 Cb -0.17 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.90 2w4r s LEU 639 CO 0.02 -0.51 0.29 -0.76 -1.32 0.00 0.00 176.35 174.06 2w4r s LEU 640 N 1.56 4.06 -0.84 -0.68 1.43 -0.52 -0.52 118.68 123.17 2w4r s LEU 640 Ca 0.57 0.21 -0.17 0.00 -1.03 0.00 0.00 54.13 53.71 2w4r s LEU 640 Cb -0.27 -2.30 0.15 0.00 0.03 0.00 0.00 46.19 43.81 2w4r s LEU 640 CO 0.26 -0.09 0.94 -0.70 0.23 0.00 0.00 176.35 177.00 2w4r s GLU 641 N 1.69 3.50 0.40 1.70 2.12 -0.35 -0.34 118.70 127.42 2w4r s GLU 641 Ca 0.12 -1.88 0.08 0.00 0.36 0.00 0.00 54.97 53.64 2w4r s GLU 641 Cb -0.15 -4.64 -0.00 0.00 0.26 0.00 0.00 34.13 29.60 2w4r s GLU 641 CO 0.09 -1.59 0.51 0.95 -0.54 0.00 0.00 175.26 174.68 2w4r s THR 642 N 1.94 3.16 0.62 -1.70 -4.23 -0.91 -2.24 115.64 112.27 2w4r s THR 642 Ca 0.24 -1.08 0.37 0.00 -1.18 0.00 0.00 61.69 60.04 2w4r s THR 642 Cb -0.10 -3.08 0.40 0.00 1.34 0.00 0.00 72.50 71.06 2w4r s THR 642 CO -0.06 -0.04 2.31 -0.65 -0.54 0.00 0.00 174.62 175.64 2w4r h PRO 643 N 0.78 0.00 -0.66 3.99 0.11 -1.97 -0.71 132.00 133.54 2w4r h PRO 643 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2w4r h PRO 643 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2w4r h PRO 643 CO 0.49 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.32 2w4r n GLN 644 N -3.51 3.61 0.00 1.05 3.00 -1.26 -4.77 117.38 115.50 2w4r n GLN 644 Ca -0.03 -2.30 0.00 0.00 -0.01 0.00 0.00 57.00 54.66 2w4r n GLN 644 Cb 0.08 -1.95 0.00 0.00 0.00 0.00 0.00 30.24 28.37 2w4r n GLN 644 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2w4r n GLY 645 N 0.66 0.16 3.76 1.08 0.00 -0.31 -4.67 105.19 105.87 2w4r n GLY 645 Ca 0.20 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 43.82 2w4r n GLY 645 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2w4r s ARG 646 N -1.12 4.49 -0.12 1.61 0.52 -1.26 -1.79 118.95 121.28 2w4r s ARG 646 Ca 0.00 1.99 -0.07 0.00 -0.52 0.00 0.00 55.73 57.13 2w4r s ARG 646 Cb 0.00 -3.16 0.04 0.00 0.52 0.00 0.00 34.95 32.36 2w4r s ARG 646 CO 0.00 -0.03 0.29 0.96 0.02 0.00 0.00 175.30 176.54 2w4r s ILE 647 N -0.83 -0.03 -0.43 1.52 -4.36 0.10 -4.55 121.20 112.63 2w4r s ILE 647 Ca 0.49 0.09 -0.14 0.00 -0.26 0.00 0.00 60.65 60.83 2w4r s ILE 647 Cb -0.35 -0.43 0.05 0.00 1.25 0.00 0.00 42.46 42.97 2w4r s ILE 647 CO 0.44 0.04 0.32 -1.58 0.24 0.00 0.00 174.94 174.40 2w4r s GLN 648 N 0.96 2.91 0.34 0.37 0.74 -1.26 -1.13 119.66 122.59 2w4r s GLN 648 Ca -0.07 -1.21 -0.27 0.00 0.05 0.00 0.00 55.36 53.86 2w4r s GLN 648 Cb -0.07 -3.98 -0.09 0.00 1.10 0.00 0.00 33.01 29.96 2w4r s GLN 648 CO -0.07 -0.88 1.11 0.00 -0.55 0.00 0.00 175.29 174.90 2w4r s ALA 649 N 1.62 3.27 -1.13 1.58 0.00 -1.26 -4.70 121.76 121.13 2w4r s ALA 649 Ca 0.04 0.87 0.25 0.00 0.00 0.00 0.00 51.96 53.12 2w4r s ALA 649 Cb -0.22 -3.33 0.52 0.00 0.00 0.00 0.00 23.12 20.09 2w4r s ALA 649 CO 0.07 -0.27 1.42 1.63 0.00 0.00 0.00 175.76 178.61 2w4r n LYS 650 N 0.59 0.15 -3.65 0.00 5.02 -1.26 -3.84 118.16 115.17 2w4r n LYS 650 Ca 0.02 -0.09 -0.12 0.00 -2.02 0.00 0.00 58.31 56.10 2w4r n LYS 650 Cb 0.46 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.90 2w4r n LYS 650 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2w4r s LYS 651 N -2.91 0.73 0.64 1.97 2.20 -1.26 -4.77 119.74 116.34 2w4r s LYS 651 Ca 0.13 1.00 0.31 0.00 -0.36 0.00 0.00 55.97 57.05 2w4r s LYS 651 Cb 0.18 0.28 1.68 0.00 -1.51 0.00 0.00 37.83 38.46 2w4r s LYS 651 CO 0.68 -0.11 1.98 -1.49 -0.36 0.00 0.00 175.35 176.04 2w4r h TRP 652 N 5.80 0.00 0.00 4.03 4.06 -1.96 0.25 115.95 128.13 2w4r h TRP 652 Ca -0.30 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.65 2w4r h TRP 652 Cb 1.18 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.34 2w4r h TRP 652 CO 0.28 0.00 -0.45 -1.13 -3.56 0.00 0.00 178.44 173.58 2w4r n SER 653 N -3.19 0.50 -0.35 -3.49 3.41 -1.26 -3.47 113.62 105.77 2w4r n SER 653 Ca 0.00 0.01 0.14 0.00 -0.26 0.00 0.00 58.87 58.76 2w4r n SER 653 Cb 0.40 0.08 0.46 0.00 -0.26 0.00 0.00 64.21 64.89 2w4r n SER 653 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2w4r n ARG 654 N -1.72 1.23 -2.05 4.33 5.12 0.87 -4.82 116.66 119.63 2w4r n ARG 654 Ca 0.05 -0.71 -0.38 0.00 -1.93 0.00 0.00 57.85 54.88 2w4r n ARG 654 Cb 0.37 -1.49 0.01 0.00 -1.16 0.00 0.00 32.46 30.19 2w4r n ARG 654 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 2w4r s VAL 655 N -2.26 2.63 0.00 1.55 -7.23 -1.24 -4.65 120.40 109.20 2w4r s VAL 655 Ca 0.31 0.50 0.00 0.00 -1.81 0.00 0.00 61.98 60.99 2w4r s VAL 655 Cb 0.20 -3.27 0.00 0.00 0.56 0.00 0.00 36.38 33.87 2w4r s VAL 655 CO 0.43 0.03 0.90 -2.65 -0.31 0.00 0.00 175.10 173.49 2w4r n PRO 656 N -0.42 0.76 -3.79 4.82 -0.02 -1.26 -4.61 135.00 130.48 2w4r n PRO 656 Ca 0.07 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.50 2w4r n PRO 656 Cb 0.45 -1.12 -0.01 0.00 -0.02 0.00 0.00 33.50 32.80 2w4r n PRO 656 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2w4r s PHE 657 N 0.28 -0.13 -0.24 6.00 -0.12 -1.26 -2.58 117.98 119.93 2w4r s PHE 657 Ca 0.00 -0.23 -0.12 0.00 -0.05 0.00 0.00 56.93 56.53 2w4r s PHE 657 Cb 0.00 0.67 -0.05 0.00 -0.63 0.00 0.00 43.02 43.01 2w4r s PHE 657 CO 0.00 -0.96 0.23 -1.12 -0.05 0.00 0.00 175.22 173.33 2w4r s SER 658 N -2.96 6.17 -0.43 1.98 0.01 -1.26 -4.90 113.70 112.30 2w4r s SER 658 Ca 0.12 0.18 -0.18 0.00 1.31 0.00 0.00 55.95 57.38 2w4r s SER 658 Cb -0.03 -2.14 0.03 0.00 0.21 0.00 0.00 66.02 64.09 2w4r s SER 658 CO 0.04 -0.01 0.50 -0.69 0.41 0.00 0.00 173.24 173.49 2w4r s VAL 659 N 1.35 5.01 0.82 3.43 1.01 -1.26 -4.84 120.40 125.93 2w4r s VAL 659 Ca 0.10 -0.26 -0.14 0.00 0.00 0.00 0.00 61.98 61.68 2w4r s VAL 659 Cb -0.14 -4.11 0.05 0.00 0.00 0.00 0.00 36.38 32.18 2w4r s VAL 659 CO 0.07 -0.50 0.91 -0.81 0.00 0.00 0.00 175.10 174.76 2w4r n PRO 660 N 5.81 0.08 -2.19 2.72 -0.04 -1.26 -4.52 135.00 135.59 2w4r n PRO 660 Ca -0.06 0.09 -0.37 0.00 -0.04 0.00 0.00 63.50 63.12 2w4r n PRO 660 Cb 0.47 -2.20 -0.00 0.00 -0.04 0.00 0.00 33.50 31.73 2w4r n PRO 660 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2w4r s ASP 661 N -2.00 6.03 0.09 3.54 1.01 -1.26 -1.29 116.67 122.79 2w4r s ASP 661 Ca 0.68 2.36 -0.31 0.00 0.71 0.00 0.00 52.55 56.00 2w4r s ASP 661 Cb -0.28 -2.61 -0.07 0.00 1.01 0.00 0.00 42.92 40.97 2w4r s ASP 661 CO 0.56 -1.02 1.26 0.12 0.21 0.00 0.00 175.17 176.30 2w4r s PHE 662 N -1.52 3.38 -0.39 4.23 5.36 -0.05 -4.53 117.98 124.45 2w4r s PHE 662 Ca 0.65 1.21 0.04 0.00 -0.96 0.00 0.00 56.93 57.86 2w4r s PHE 662 Cb -0.30 -3.50 0.11 0.00 -0.34 0.00 0.00 43.02 38.99 2w4r s PHE 662 CO 0.36 -1.61 0.12 0.34 -1.46 0.00 0.00 175.22 172.96 2w4r s ASP 663 N 0.98 4.68 0.26 6.13 2.15 -1.26 -4.79 116.67 124.82 2w4r s ASP 663 Ca 0.60 -2.38 -0.01 0.00 0.43 0.00 0.00 52.55 51.18 2w4r s ASP 663 Cb -0.32 -1.64 0.58 0.00 -0.30 0.00 0.00 42.92 41.23 2w4r s ASP 663 CO 0.30 -0.35 1.69 0.15 -0.17 0.00 0.00 175.17 176.79 2w4r h PHE 664 N 7.34 0.43 -0.38 -5.34 3.04 -2.00 -0.98 116.94 119.06 2w4r h PHE 664 Ca -0.05 0.04 0.05 0.00 3.98 0.00 0.00 57.97 61.99 2w4r h PHE 664 Cb 0.99 -0.06 -0.04 0.00 2.56 0.00 0.00 35.95 39.39 2w4r h PHE 664 CO 0.48 -0.07 0.12 1.25 -2.02 0.00 0.00 178.31 178.07 2w4r h LEU 665 N 0.33 0.11 -0.50 0.59 6.46 -2.00 -1.24 115.31 119.06 2w4r h LEU 665 Ca 0.48 0.05 -0.16 0.00 -0.12 0.00 0.00 57.88 58.12 2w4r h LEU 665 Cb 0.86 0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.82 2w4r h LEU 665 CO -0.52 0.10 -0.56 -0.61 -0.62 0.00 0.00 178.44 176.23 2w4r h GLN 666 N 0.27 0.57 -0.05 1.25 5.75 -1.65 -1.23 115.11 120.01 2w4r h GLN 666 Ca 0.17 -0.36 0.02 0.00 -0.15 0.00 0.00 58.65 58.33 2w4r h GLN 666 Cb 0.17 0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.73 2w4r h GLN 666 CO -0.19 0.97 -0.10 1.25 -2.65 0.00 0.00 178.83 178.12 2w4r h HIS 667 N 0.44 -0.24 -0.55 3.99 2.76 -1.08 -1.59 115.15 118.87 2w4r h HIS 667 Ca 0.01 0.01 0.09 0.00 -2.20 0.00 0.00 60.37 58.28 2w4r h HIS 667 Cb 1.10 0.12 -0.07 0.00 1.55 0.00 0.00 27.41 30.11 2w4r h HIS 667 CO 0.05 -0.15 0.16 0.00 -1.30 0.00 0.00 177.93 176.69 2w4r h ALA 669 N 1.40 1.57 0.00 0.00 0.00 -0.73 -0.50 119.26 121.00 2w4r h ALA 669 Ca 0.28 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2w4r h ALA 669 Cb 0.35 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2w4r h ALA 669 CO -0.31 0.33 -0.48 0.93 0.00 0.00 0.00 179.25 179.73 2w4r h GLU 670 N 0.51 0.00 0.00 0.00 5.08 -0.77 -3.36 114.58 116.03 2w4r h GLU 670 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2w4r h GLU 670 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 2w4r h GLU 670 CO -0.01 0.00 -0.04 0.09 -1.00 0.00 0.00 179.01 178.04 2w4r n ASN 671 N -2.69 1.36 -0.04 1.42 3.02 -0.67 -4.78 115.26 112.89 2w4r n ASN 671 Ca 0.03 -1.92 -0.13 0.00 -0.03 0.00 0.00 54.58 52.52 2w4r n ASN 671 Cb 0.51 -0.09 -0.08 0.00 -0.61 0.00 0.00 39.78 39.51 2w4r n ASN 671 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 2w4r h LEU 672 N 0.00 0.25 -1.44 3.41 5.85 -1.32 -1.71 115.31 120.34 2w4r h LEU 672 Ca 0.00 -0.49 -0.06 0.00 0.84 0.00 0.00 57.88 58.17 2w4r h LEU 672 Cb 0.79 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 2w4r h LEU 672 CO 0.00 0.69 -0.28 0.77 -0.34 0.00 0.00 178.44 179.27 2w4r h SER 673 N -0.19 0.00 0.34 1.25 4.64 -1.90 0.85 113.55 118.55 2w4r h SER 673 Ca 0.01 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.03 2w4r h SER 673 Cb 0.62 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.73 2w4r h SER 673 CO 0.02 0.28 -1.32 0.44 -0.87 0.00 0.00 176.83 175.38 2w4r h ASP 674 N 0.00 0.71 1.28 4.97 3.32 -1.94 -3.29 116.42 121.48 2w4r h ASP 674 Ca -0.00 -0.72 0.00 0.00 0.02 0.00 0.00 57.03 56.32 2w4r h ASP 674 Cb 0.51 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.83 2w4r h ASP 674 CO 0.04 1.55 -0.05 0.18 -1.72 0.00 0.00 179.24 179.24 2w4r n LEU 675 N -3.68 0.57 -4.73 1.55 4.77 -0.66 -4.79 117.00 110.03 2w4r n LEU 675 Ca -0.13 0.52 -0.42 0.00 -0.03 0.00 0.00 56.01 55.95 2w4r n LEU 675 Cb 1.04 -0.36 -0.03 0.00 -2.33 0.00 0.00 43.42 41.74 2w4r n LEU 675 CO 0.58 -0.11 1.08 -0.55 -1.33 0.00 0.00 177.39 177.05 2w4r s SER 676 N -4.04 6.77 0.02 -1.43 0.15 0.29 -4.89 113.70 110.58 2w4r s SER 676 Ca 0.11 2.45 -0.30 0.00 0.70 0.00 0.00 55.95 58.91 2w4r s SER 676 Cb 0.14 -2.60 -0.04 0.00 -1.71 0.00 0.00 66.02 61.81 2w4r s SER 676 CO 0.59 -0.66 1.14 -0.76 1.20 0.00 0.00 173.24 174.74 2w4r s LEU 677 N 0.55 4.35 0.00 3.45 1.43 -1.26 -4.92 118.68 122.28 2w4r s LEU 677 Ca 0.63 1.87 0.00 0.00 -1.03 0.00 0.00 54.13 55.60 2w4r s LEU 677 Cb -0.39 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.26 2w4r s LEU 677 CO 0.35 -0.44 0.00 -0.90 0.23 0.00 0.00 176.35 175.59